4-Hydroxy-4'-nitrobiphenyl

Base Information

• Chemical Name: 4-Hydroxy-4'-nitrobiphenyl
• CAS No.: 3916-44-7
• Molecular Formula: C12H9 N O3
• Molecular Weight: 215.208
• Hs Code.: 29071990
• European Community (EC) Number: 679-959-8
• NSC Number: 95704
• DSSTox Substance ID: DTXSID10192400
• Nikkaji Number: J2.733.891G
• Wikidata: Q72480697
• Mol file: 3916-44-7.mol

Synonyms:4-Hydroxy-4'-nitrobiphenyl;3916-44-7;4'-Nitro-[1,1'-biphenyl]-4-ol;4-(4-nitrophenyl)phenol;4'-nitro-biphenyl-4-ol;4'-Nitrobiphenyl-4-ol;NSC95704;[1,1'-Biphenyl]-4-ol, 4'-nitro-;4'-Nitro-4-biphenylol;4-hydroxy-4'nitrobiphenyl;4-(4'-nitrophenyl)phenol;4-(4-Nitrophenyl)phenolate;NCIOpen2_005792;Oprea1_616792;4'-hydroxy-4-nitro-biphenyl;SCHEMBL1539361;4'-hydroxy-(4-nitro biphenyl);DTXSID10192400;4'-nitro-1,1'-biphenyl-4-ol;4'-Nitro[1,1'-biphenyl]-4-ol;MFCD00047742;NSC 95704;NSC-95704;AKOS015856523;4'-Nitro[1,1'-biphenyl]-4-ol #;AC-26256;AS-59800;CS-0187046;FT-0618653;H0747;T72419;A824435

Chemical Property of 4-Hydroxy-4'-nitrobiphenyl

Chemical Property:

• Melting Point: 207°C
• Boiling Point: 387.3°Cat760mmHg
• PKA: 9.22±0.13(Predicted)
• Flash Point: 168.6°C
• PSA: 66.05000
• Density: 1.304g/cm³
• LogP: 3.49060
• Solubility.: almost transparency in Methanol
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 215.058243149
• Heavy Atom Count: 16
• Complexity: 235

Purity/Quality:

99% ^*data from raw suppliers

4-Hydroxy-4''-nitrobiphenyl ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 36/37/39

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)O)[N+](=O)[O-]
• Uses: 4-HYDROXY-4'-NITROBIPHENYL can be used as intermediates in organic synthesis.

Technology Process of 4-Hydroxy-4'-nitrobiphenyl

There total 14 articles about 4-Hydroxy-4'-nitrobiphenyl which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 95.0%

4-bromo-phenol (106-41-2) + 4-nitrophenylboronic acid (24067-17-2) → 4-(4-nitrophenyl)phenol (3916-44-7)

Guidance literature:

With potassium carbonate; In ethanol; water; at 20 ℃; for 1h;

DOI:10.1016/j.cclet.2015.08.007

Reference yield: 95.0%

para-nitrophenyl bromide (586-78-7) + 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol (269409-70-3) → 4-(4-nitrophenyl)phenol (3916-44-7)

Guidance literature:

With sodium phosphate; palladium on activated charcoal; In water; isopropyl alcohol; at 20 ℃; for 8h;

DOI:10.1016/j.tet.2007.08.017

Reference yield: 72.0%

4-(benzoyloxy)-4'-nitrobiphenyl (3916-45-8) → 4-(4-nitrophenyl)phenol (3916-44-7)

Guidance literature:

4-(benzoyloxy)-4'-nitrobiphenyl; With potassium carbonate; In ethanol; water; at 80 ℃; for 24h;

With hydrogenchloride; water; In ethanol;

DOI:10.1002/cphc.201000444

upstream raw materials:

4-amino-4'-nitrobiphenyl

4-(benzoyloxy)-4'-nitrobiphenyl

p-nitrobenzene iodide

1,4-Phenyldiboronic acid

Downstream raw materials:

4-amino-4'-hydroxybiphenyl

4-dichloroacetoxy-4-(4'-nitrophenyl)-2,5-cyclohexadienone

2-(4'-nitro-biphenyl-4-yloxy)-3-phenyl-propionic acid methyl ester

4-nitrobiphenyl-4'-ferrocenyl benzoate

Refernces

• 1、 -. "NOVEL HYDROXYPHENYL BORONIC ESTER, MANUFACTURING METHOD THEREFOR, AND MANUFACTURING METHOD OF HYDROXYPHENYL COMPOUND". Paragraph 0068; 0069. . Retrieved 2017/04/19.
• 2、 Liu, Ming,Zheng, Xinguo,Gong, Shiming,Liu, Lulu,Sun, Zhen,Shao, Leishan,Wang, Yinghan. "Effect of the functional diamine structure on the properties of a polyimide liquid crystal alignment film". . p. 25348 - 25356. Retrieved 2015/03/30.